U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ABSOLUTE
Molecular Formula C28H36N4O6S2
Molecular Weight 588.739
Optical Activity UNSPECIFIED
Defined Stereocenters 4 / 4
E/Z Centers 0
Charge 0
Stereo Comments MESO

SHOW SMILES / InChI
Structure of TEGAVIVINT

SMILES

C[C@H]1C[C@@H](C)CN(C1)S(=O)(=O)C2=CC=C3C(=C2)C(=NO)C4=CC(=CC=C4C3=NO)S(=O)(=O)N5C[C@@H](C)C[C@@H](C)C5

InChI

InChIKey=GAPRVZKWPDRAJA-QOPKLXIQSA-N
InChI=1S/C28H36N4O6S2/c1-17-9-18(2)14-31(13-17)39(35,36)21-5-7-23-25(11-21)28(30-34)26-12-22(6-8-24(26)27(23)29-33)40(37,38)32-15-19(3)10-20(4)16-32/h5-8,11-12,17-20,33-34H,9-10,13-16H2,1-4H3/b29-27-,30-28-/t17-,18+,19-,20+

HIDE SMILES / InChI

Approval Year

Name Type Language
TEGAVIVINT
INN  
Official Name English
9,10-ANTHRACENEDIONE, 2,7-BIS(((3R,5S)-3,5-DIMETHYL-1-PIPERIDINYL)SULFONYL)-, 9,10-DIOXIME, REL-
Systematic Name English
tegavivint [INN]
Common Name English
BC-2059
Code English
Tegavivint [WHO-DD]
Common Name English
Classification Tree Code System Code
FDA ORPHAN DRUG 912222
Created by admin on Sat Dec 16 14:36:09 GMT 2023 , Edited by admin on Sat Dec 16 14:36:09 GMT 2023
FDA ORPHAN DRUG 923322
Created by admin on Sat Dec 16 14:36:09 GMT 2023 , Edited by admin on Sat Dec 16 14:36:09 GMT 2023
FDA ORPHAN DRUG 634118
Created by admin on Sat Dec 16 14:36:09 GMT 2023 , Edited by admin on Sat Dec 16 14:36:09 GMT 2023
NCI_THESAURUS C2189
Created by admin on Sat Dec 16 14:36:09 GMT 2023 , Edited by admin on Sat Dec 16 14:36:09 GMT 2023
Code System Code Type Description
SMS_ID
100000181192
Created by admin on Sat Dec 16 14:36:09 GMT 2023 , Edited by admin on Sat Dec 16 14:36:09 GMT 2023
PRIMARY
NCI_THESAURUS
C155885
Created by admin on Sat Dec 16 14:36:09 GMT 2023 , Edited by admin on Sat Dec 16 14:36:09 GMT 2023
PRIMARY
INN
10583
Created by admin on Sat Dec 16 14:36:09 GMT 2023 , Edited by admin on Sat Dec 16 14:36:09 GMT 2023
PRIMARY
PUBCHEM
46212391
Created by admin on Sat Dec 16 14:36:09 GMT 2023 , Edited by admin on Sat Dec 16 14:36:09 GMT 2023
PRIMARY
CAS
1227637-23-1
Created by admin on Sat Dec 16 14:36:09 GMT 2023 , Edited by admin on Sat Dec 16 14:36:09 GMT 2023
PRIMARY
FDA UNII
18AP231HUP
Created by admin on Sat Dec 16 14:36:09 GMT 2023 , Edited by admin on Sat Dec 16 14:36:09 GMT 2023
PRIMARY